SCHEMBL4885835

SCHEMBL4885835

OC(CN1CCCN(CCc2ccc3c(c2)OCO3)CC1)C(O)(c1ccccc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 3/20 0.48
ADRA1A P35348 3/20 0.48
ADRA1B P35368 3/20 0.48
CHRM3 P20309 1/20 0.47
KDM4E B2RXH2 2/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 1/20 0.46
ALDH1A1 P00352 2/20 0.45
KMT2A Q03164 1/20 0.44
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
TSHR P16473 2/20 0.44
FAAH O00519 1/20 0.44
HSD17B10 Q99714 1/20 0.43
USP2 O75604 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4886415 0.87 CHRM3 (0.53) ADRA1DADRA1AADRA1BCHRM3KDM4E
SCHEMBL4889319 0.84 CHRM3 (0.54) ADRA1DADRA1AADRA1BCHRM3KDM4E
SCHEMBL4883207 0.80 ADRA1D (0.52) ADRA1DADRA1AADRA1BCHRM3KDM4E
SCHEMBL5277053 0.77 ADRA1D (0.55) ADRA1DADRA1AADRA1BKDM4EALDH1A1
SCHEMBL11698547 0.76 DPP7 (0.67) ADRA1DADRA1AADRA1BALDH1A1
SCHEMBL20689718 0.76 ADRA1D (0.65) ADRA1DADRA1AADRA1B
SCHEMBL4885842 0.75 CHRM3 (0.57) ADRA1DADRA1AADRA1BCHRM3KDM4E
SCHEMBL8983764 0.75 CHRM3 (0.50) ADRA1DADRA1AADRA1BCHRM3KDM4E
SCHEMBL11261146 0.74 DPP7 (0.65) ADRA1DADRA1AADRA1BALDH1A1KMT2A
SCHEMBL14003889 0.74 SIGMAR1 (0.60) ADRA1DADRA1AADRA1BCHRM3TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080280883-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-11-13 US claimed
US-20080280883-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-11-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080280883-A1 Muscarinic Receptor Antagonists CHRM3, CHRM5, CHRM2 ADRA1D 82/4885ADRA1A 70/4885ADRA1B 71/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.